2-[1-carbamimidoyl-2-(4-methoxycarbonylphenyl)piperidin-4-yl]propanoate hydrochloride

Systemtic Name: 2-[1-carbamimidoyl-2-(4-methoxycarbonylphenyl)piperidin-4-yl]propanoate hydrochloride Openeye Name: 2-[1-carbamimidoyl-2-(4-methoxycarbonylphenyl)-4-piperidyl]propanoate hydrochloride CAS Name: 2-[1-carbamimidoyl-2-(4-methoxycarbonylphenyl)-4-piperidinyl]propanoate hydrochloride IUPAC Name: 2-[1-carbamimidoyl-2-(4-methoxycarbonylphenyl)piperidin-4-yl]propanoate hydrochloride Traditional Name: 2-[1-amidino-2-(4-carbomethoxyphenyl)-4-piperidyl]propionate hydrochloride Formula: C17H23ClN3O4- MolecularWeight: 368.83522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCN(C(C1)C2=CC=C(C=C2)C(=O)OC)C(=N)N)C(=O)[O-].Cl

Isomeric SMILES

CC(C1CCN(C(C1)C2=CC=C(C=C2)C(=O)OC)C(=N)N)C(=O)[O-].Cl

InChI

InChI=1S/C17H23N3O4.ClH/c1-10(15(21)22)13-7-8-20(17(18)19)14(9-13)11-3-5-12(6-4-11)16(23)24-2;/h3-6,10,13-14H,7-9H2,1-2H3,(H3,18,19)(H,21,22);1H/p-1